2-(4-Fluorophenyl)-4-(3-Hydroxy-3-Methylbutoxy)-5-[4-(Methylsulfonyl)Phenyl]-3(2H)-Pyridazinone
[CAS# 221030-56-4]

Identification

• Name: 2-(4-Fluorophenyl)-4-(3-Hydroxy-3-Methylbutoxy)-5-[4-(Methylsulfonyl)Phenyl]-3(2H)-Pyridazinone
• Synonyms: 3(2H)-PYRIDAZINONE,2-(4-FLUOROPHENYL)-4-(3-HYDROXY-3-METHYLBUTOXY)-5-[4-(METHYLSULFONYL)PHENYL]-
• Molecular Formula: C₂₂H₂₃FN₂O₅S
• Molecular Weight: 446.49
• CAS Registry Number: 221030-56-4
• SMILES: O=S(=O)(c3ccc(C=2\C=N/N(c1ccc(F)cc1)C(=O)C=2OCCC(O)(C)C)cc3)C
• InChI: 1S/C22H23FN2O5S/c1-22(2,27)12-13-30-20-19(15-4-10-18(11-5-15)31(3,28)29)14-24-25(21(20)26)17-8-6-16(23)7-9-17/h4-11,14,27H,12-13H2,1-3H3
• InChIKey: PORJADFRTDGOOL-UHFFFAOYSA-N

Properties

• Density: 1.3g/cm³ (Cal.)
• Boiling point: 662.663°C at 760 mmHg (Cal.)
• Flash point: 354.566°C (Cal.)
• Refractive index: 1.591 (Cal.)